|
PDBeChem : Molecule Descriptors
Molecule : R2U
Encodings of molecule in descriptor strings
Record | Name | Program | Version | Name |
1 |
InChI
|
InChI |
1.06 |
InChI=1S/6H2O.2Ru/h6*1H2;;/q;;;;;;2*+3/p-6 |
2 |
InChIKey
|
InChI |
1.06 |
AOQXTNLYRQGSLC-UHFFFAOYSA-H |
3 |
SMILES
|
CACTVS |
3.385 |
O[Ru](O)(O)[Ru](O)(O)O |
4 |
SMILES
|
OpenEye OEToolkits |
3.1.0.0 |
O[Ru](O)(O)[Ru](O)(O)O |
5 |
Canonical SMILES
|
CACTVS |
3.385 |
O[Ru](O)(O)[Ru](O)(O)O |
6 |
Canonical SMILES
|
OpenEye OEToolkits |
3.1.0.0 |
O[Ru](O)(O)[Ru](O)(O)O |
|